SCHEMBL4046938

SCHEMBL4046938

CCN(CC)C(=O)c1ccc([Se]C)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.59
ALDH1A1 P00352 4/20 0.59
MAPT P10636 2/20 0.59
MLYCD O95822 2/20 0.58
LMNA P02545 3/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HSP90AA1 P07900 5/20 0.51
HSP90AB1 P08238 5/20 0.51
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 1/20 0.47
BLM P54132 1/20 0.47
GAA P10253 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5703500 0.87 HPGD (0.73) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL4049637 0.82 HPGD (0.58) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL8991703 0.79 MLYCD (0.67) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL1806308 0.79 HPGD (0.63) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL6802252 0.79 HPGD (0.69) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL121475 0.79 HPGD (0.66) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL1018549 0.78 HPGD (0.61) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL3559829 0.78 HPGD (0.61) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL471629 0.78 HPGD (0.61) HPGDALDH1A1MAPTMLYCDLMNA
SCHEMBL1934529 0.78 HPGD (0.61) HPGDALDH1A1MAPTMLYCDLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2009102243-A ACTIVE OXYGEN SCAVENGER IN LIVING CELL CHARACTERIZED BY CONTAINING SELENOAMIDE AND ITS USE GUNMA PREFECTURE 2009-05-14 JP disclosed